DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:39:57 UTC
Update Date	2025-03-25 00:46:31 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02155705
Frequency	0.5
Structure
Chemical Formula	C₁₆H₂₄N₂O₃
Molecular Mass	292.1787
SMILES	Cc1cccc(C)c1NC(=O)CCCNCCCC(=O)O
InChI Key	PXGFLSAIKNBSFK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	gamma amino acids and derivatives
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	amino acids anilides carbonyl compounds carboxylic acids dialkylamines fatty amides hydrocarbon derivatives monocarboxylic acids and derivatives n-arylamides organic oxides organopnictogen compounds secondary carboxylic acid amides m-xylenes
Substituents	fatty acyl monocyclic benzene moiety carbonyl group carboxylic acid amino acid gamma amino acid or derivatives fatty amide n-arylamide xylene organic oxide organonitrogen compound organopnictogen compound secondary aliphatic amine m-xylene secondary amine carboxamide group aromatic homomonocyclic compound anilide secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound hydrocarbon derivative benzenoid organic nitrogen compound organooxygen compound amine

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